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ZINC Item

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12227877

Analogs

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Popular Name: N-(2-fluorophenyl)-2-(4-methyl-7-oxo-1-phenyl-pyrazolo[4,5-d]pyridazin-6-yl)acetamide N-(2-fluorophenyl)-2-(4-methyl-7…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.21	1.26	-19.71	1	7	0	82	377.379	4	↓ MOL2 SDF SMILES Flexibase

12227883

Analogs

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Popular Name: N-(3-fluorophenyl)-2-(4-methyl-7-oxo-1-phenyl-pyrazolo[4,5-d]pyridazin-6-yl)acetamide N-(3-fluorophenyl)-2-(4-methyl-7…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.24	1.23	-23.1	1	7	0	82	377.379	4	↓ MOL2 SDF SMILES Flexibase

12227887

Analogs

12228268

Draw Identity 99% 90% 80% 70%

Popular Name: N-(4-fluorophenyl)-2-(4-methyl-7-oxo-1-phenyl-pyrazolo[4,5-d]pyridazin-6-yl)acetamide N-(4-fluorophenyl)-2-(4-methyl-7…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.26	1.22	-20.76	1	7	0	82	377.379	4	↓ MOL2 SDF SMILES Flexibase

12227893

Analogs

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Popular Name: N-(2,4-difluorophenyl)-2-(4-methyl-7-oxo-1-phenyl-pyrazolo[4,5-d]pyridazin-6-yl)acetamide N-(2,4-difluorophenyl)-2-(4-meth…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.35	2.01	-18.13	1	7	0	82	395.369	4	↓ MOL2 SDF SMILES Flexibase

12227900

Analogs

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Popular Name: N-(2,4-dimethoxyphenyl)-2-(4-methyl-7-oxo-1-phenyl-pyrazolo[4,5-d]pyridazin-6-yl)acetamide N-(2,4-dimethoxyphenyl)-2-(4-met…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.14	0.62	-21.27	1	9	0	100	419.441	6	↓ MOL2 SDF SMILES Flexibase

12227906

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,5-dimethoxyphenyl)-2-(4-methyl-7-oxo-1-phenyl-pyrazolo[4,5-d]pyridazin-6-yl)acetamide N-(2,5-dimethoxyphenyl)-2-(4-met…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.14	0.62	-23.59	1	9	0	100	419.441	6	↓ MOL2 SDF SMILES Flexibase

12227912

Analogs

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Popular Name: N-(3,4-dimethoxyphenyl)-2-(4-methyl-7-oxo-1-phenyl-pyrazolo[4,5-d]pyridazin-6-yl)acetamide N-(3,4-dimethoxyphenyl)-2-(4-met…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.74	0.81	-23.48	1	9	0	100	419.441	6	↓ MOL2 SDF SMILES Flexibase

12227931

Analogs

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Popular Name: 2-(4-methyl-7-oxo-1-phenyl-pyrazolo[4,5-d]pyridazin-6-yl)-N-[2-(trifluoromethyl)phenyl]acetamide 2-(4-methyl-7-oxo-1-phenyl-pyraz…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.95	2.92	-19.04	1	7	0	82	427.386	5	↓ MOL2 SDF SMILES Flexibase

12227937

Analogs

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Popular Name: 2-(4-methyl-7-oxo-1-phenyl-pyrazolo[4,5-d]pyridazin-6-yl)-N-[3-(trifluoromethyl)phenyl]acetamide 2-(4-methyl-7-oxo-1-phenyl-pyraz…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.97	2.64	-19.21	1	7	0	82	427.386	5	↓ MOL2 SDF SMILES Flexibase

12227943

Analogs

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Popular Name: 2-(4-methyl-7-oxo-1-phenyl-pyrazolo[4,5-d]pyridazin-6-yl)-N-[4-(trifluoromethyl)phenyl]acetamide 2-(4-methyl-7-oxo-1-phenyl-pyraz…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.99	2.65	-20.65	1	7	0	82	427.386	5	↓ MOL2 SDF SMILES Flexibase

12227948

Analogs

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Popular Name: 2-(4-methyl-7-oxo-1-phenyl-pyrazolo[4,5-d]pyridazin-6-yl)-N-[4-(trifluoromethoxy)phenyl]acetamide 2-(4-methyl-7-oxo-1-phenyl-pyraz…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.07	2.01	-19.77	1	8	0	91	443.385	6	↓ MOL2 SDF SMILES Flexibase

12227953

Analogs

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Popular Name: methyl methyl

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.27	1.61	-22.74	1	9	0	108	417.425	6	↓ MOL2 SDF SMILES Flexibase

12227957

Analogs

13970511

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Popular Name: N-(3-acetamidophenyl)-2-(4-methyl-7-oxo-1-phenyl-pyrazolo[4,5-d]pyridazin-6-yl)acetamide N-(3-acetamidophenyl)-2-(4-methy…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.29	-0.63	-24.66	2	9	0	111	416.441	5	↓ MOL2 SDF SMILES Flexibase

12227963

Analogs

13970511

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Popular Name: N-(4-acetamidophenyl)-2-(4-methyl-7-oxo-1-phenyl-pyrazolo[4,5-d]pyridazin-6-yl)acetamide N-(4-acetamidophenyl)-2-(4-methy…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.32	-0.62	-25.91	2	9	0	111	416.441	5	↓ MOL2 SDF SMILES Flexibase

12228018

Analogs

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Popular Name: 4-[[2-(4-methyl-7-oxo-1-phenyl-pyrazolo[4,5-d]pyridazin-6-yl)acetyl]amino]benzamide 4-[[2-(4-methyl-7-oxo-1-phenyl-p…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.92	-2.23	-24.58	3	9	0	125	402.414	5	↓ MOL2 SDF SMILES Flexibase

12228101

Analogs

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Popular Name: 2-[1-(3-chlorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]-N-(2-fluorophenyl)acetamide 2-[1-(3-chlorophenyl)-4-methyl-7…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.08	1.11	-20.15	1	7	0	82	411.824	4	↓ MOL2 SDF SMILES Flexibase

12228105

Analogs

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Popular Name: 2-[1-(3-chlorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]-N-(3-fluorophenyl)acetamide 2-[1-(3-chlorophenyl)-4-methyl-7…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.10	1.09	-23.22	1	7	0	82	411.824	4	↓ MOL2 SDF SMILES Flexibase

12228110

Analogs

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Popular Name: 2-[1-(3-chlorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]-N-(4-fluorophenyl)acetamide 2-[1-(3-chlorophenyl)-4-methyl-7…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.13	1.08	-20.93	1	7	0	82	411.824	4	↓ MOL2 SDF SMILES Flexibase

12228234

Analogs

12228239

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Popular Name: N-(2,3-dimethylphenyl)-2-[1-(4-fluorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(2,3-dimethylphenyl)-2-[1-(4-f…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.06	1.99	-19.39	1	7	0	82	405.433	4	↓ MOL2 SDF SMILES Flexibase

12228239

Analogs

12228234

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,5-dimethylphenyl)-2-[1-(4-fluorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(2,5-dimethylphenyl)-2-[1-(4-f…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.09	2.09	-19.38	1	7	0	82	405.433	4	↓ MOL2 SDF SMILES Flexibase

12228247

Analogs

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Popular Name: N-(2,4-dimethylphenyl)-2-[1-(4-fluorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(2,4-dimethylphenyl)-2-[1-(4-f…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.09	2.09	-19.35	1	7	0	82	405.433	4	↓ MOL2 SDF SMILES Flexibase

12228253

Analogs

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Popular Name: N-(3,5-dimethylphenyl)-2-[1-(4-fluorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(3,5-dimethylphenyl)-2-[1-(4-f…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.09	1.86	-19.05	1	7	0	82	405.433	4	↓ MOL2 SDF SMILES Flexibase

12228256

Analogs

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Popular Name: N-(2-fluorophenyl)-2-[1-(4-fluorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(2-fluorophenyl)-2-[1-(4-fluor…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.38	2	-17.91	1	7	0	82	395.369	4	↓ MOL2 SDF SMILES Flexibase

12228263

Analogs

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Popular Name: N-(3-fluorophenyl)-2-[1-(4-fluorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(3-fluorophenyl)-2-[1-(4-fluor…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.40	1.95	-17.84	1	7	0	82	395.369	4	↓ MOL2 SDF SMILES Flexibase

12228268

Analogs

12228344
12227887

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Popular Name: N-(4-fluorophenyl)-2-[1-(4-fluorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(4-fluorophenyl)-2-[1-(4-fluor…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.42	1.95	-18.85	1	7	0	82	395.369	4	↓ MOL2 SDF SMILES Flexibase

12228273

Analogs

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Popular Name: N-(2,4-dimethoxyphenyl)-2-[1-(4-fluorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(2,4-dimethoxyphenyl)-2-[1-(4-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.30	1.36	-19.39	1	9	0	100	437.431	6	↓ MOL2 SDF SMILES Flexibase

12228278

Analogs

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Popular Name: N-(2,5-dimethoxyphenyl)-2-[1-(4-fluorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(2,5-dimethoxyphenyl)-2-[1-(4-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.30	1.35	-21.55	1	9	0	100	437.431	6	↓ MOL2 SDF SMILES Flexibase

12228299

Analogs

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Popular Name: N-(3,4-dimethoxyphenyl)-2-[1-(4-fluorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(3,4-dimethoxyphenyl)-2-[1-(4-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.91	1.55	-21.57	1	9	0	100	437.431	6	↓ MOL2 SDF SMILES Flexibase

12228323

Analogs

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Popular Name: 2-[1-(4-fluorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]-N-[3-(trifluoromethyl)phenyl]ace 2-[1-(4-fluorophenyl)-4-methyl-7…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.13	3.39	-17.78	1	7	0	82	445.376	5	↓ MOL2 SDF SMILES Flexibase

12228331

Analogs

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Popular Name: 2-[1-(4-fluorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]-N-[4-(trifluoromethyl)phenyl]ace 2-[1-(4-fluorophenyl)-4-methyl-7…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.16	3.4	-18.86	1	7	0	82	445.376	5	↓ MOL2 SDF SMILES Flexibase

12228336

Analogs

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Popular Name: methyl methyl

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.43	2.35	-21.07	1	9	0	108	435.415	6	↓ MOL2 SDF SMILES Flexibase

12228344

Analogs

12228268

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Popular Name: N-(3-acetamidophenyl)-2-[1-(4-fluorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(3-acetamidophenyl)-2-[1-(4-fl…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.46	0.11	-23	2	9	0	111	434.431	5	↓ MOL2 SDF SMILES Flexibase

12228348

Analogs

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Popular Name: N-(4-acetamidophenyl)-2-[1-(4-fluorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(4-acetamidophenyl)-2-[1-(4-fl…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.48	0.14	-24.13	2	9	0	111	434.431	5	↓ MOL2 SDF SMILES Flexibase

12228407

Analogs

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Popular Name: 4-[[2-[1-(4-fluorophenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetyl]amino]benzamide 4-[[2-[1-(4-fluorophenyl)-4-meth…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.08	-1.5	-22.93	3	9	0	125	420.404	5	↓ MOL2 SDF SMILES Flexibase

12228473

Analogs

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Popular Name: N-(2-fluorophenyl)-2-[4-methyl-1-(o-tolyl)-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(2-fluorophenyl)-2-[4-methyl-1…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.83	1.69	-20.31	1	7	0	82	391.406	4	↓ MOL2 SDF SMILES Flexibase

12228480

Analogs

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Popular Name: N-(3-fluorophenyl)-2-[4-methyl-1-(o-tolyl)-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(3-fluorophenyl)-2-[4-methyl-1…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.85	1.66	-20.13	1	7	0	82	391.406	4	↓ MOL2 SDF SMILES Flexibase

12228485

Analogs

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Popular Name: N-(4-fluorophenyl)-2-[4-methyl-1-(o-tolyl)-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(4-fluorophenyl)-2-[4-methyl-1…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.87	1.65	-21.09	1	7	0	82	391.406	4	↓ MOL2 SDF SMILES Flexibase

12228493

Analogs

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Popular Name: N-(2,4-difluorophenyl)-2-[4-methyl-1-(o-tolyl)-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(2,4-difluorophenyl)-2-[4-meth…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.97	2.42	-18.69	1	7	0	82	409.396	4	↓ MOL2 SDF SMILES Flexibase

12228499

Analogs

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Popular Name: N-(2,4-dimethoxyphenyl)-2-[4-methyl-1-(o-tolyl)-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(2,4-dimethoxyphenyl)-2-[4-met…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.75	1.05	-21.81	1	9	0	100	433.468	6	↓ MOL2 SDF SMILES Flexibase

12228509

Analogs

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Popular Name: N-(2,5-dimethoxyphenyl)-2-[4-methyl-1-(o-tolyl)-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(2,5-dimethoxyphenyl)-2-[4-met…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.75	1.04	-24.14	1	9	0	100	433.468	6	↓ MOL2 SDF SMILES Flexibase

12228515

Analogs

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Popular Name: N-(3,4-dimethoxyphenyl)-2-[4-methyl-1-(o-tolyl)-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetamide N-(3,4-dimethoxyphenyl)-2-[4-met…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.36	1.31	-23.75	1	9	0	100	433.468	6	↓ MOL2 SDF SMILES Flexibase

12228536

Analogs

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Popular Name: 2-[4-methyl-1-(o-tolyl)-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]-N-[2-(trifluoromethyl)phenyl]acetamide 2-[4-methyl-1-(o-tolyl)-7-oxo-py…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.56	3.34	-19.76	1	7	0	82	441.413	5	↓ MOL2 SDF SMILES Flexibase

12228543

Analogs

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Popular Name: 2-[4-methyl-1-(o-tolyl)-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]-N-[3-(trifluoromethyl)phenyl]acetamide 2-[4-methyl-1-(o-tolyl)-7-oxo-py…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.58	3.1	-19.93	1	7	0	82	441.413	5	↓ MOL2 SDF SMILES Flexibase

12228546

Analogs

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Popular Name: 2-[4-methyl-1-(o-tolyl)-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]-N-[4-(trifluoromethyl)phenyl]acetamide 2-[4-methyl-1-(o-tolyl)-7-oxo-py…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.61	3.07	-20.87	1	7	0	82	441.413	5	↓ MOL2 SDF SMILES Flexibase

12228550

Analogs

12228692

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Popular Name: methyl methyl

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.88	2.05	-23.12	1	9	0	108	431.452	6	↓ MOL2 SDF SMILES Flexibase

12228587

Analogs

12228730

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Popular Name: 4-[[2-[4-methyl-1-(o-tolyl)-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetyl]amino]benzamide 4-[[2-[4-methyl-1-(o-tolyl)-7-ox…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.53	-1.78	-24.42	3	9	0	125	416.441	5	↓ MOL2 SDF SMILES Flexibase

12228645

Analogs

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Popular Name: 2-[1-(2,4-dimethylphenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]-N-(4-fluorophenyl)acetamide 2-[1-(2,4-dimethylphenyl)-4-meth…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.30	1.97	-20.95	1	7	0	82	405.433	4	↓ MOL2 SDF SMILES Flexibase

12228651

Analogs

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Popular Name: N-(2,4-difluorophenyl)-2-[1-(2,4-dimethylphenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]acetam N-(2,4-difluorophenyl)-2-[1-(2,4…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.39	2.8	-18.01	1	7	0	82	423.423	4	↓ MOL2 SDF SMILES Flexibase

12228660

Analogs

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Popular Name: N-(2,4-dimethoxyphenyl)-2-[1-(2,4-dimethylphenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]aceta N-(2,4-dimethoxyphenyl)-2-[1-(2,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.18	1.44	-21.23	1	9	0	100	447.495	6	↓ MOL2 SDF SMILES Flexibase

12228667

Analogs

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Popular Name: N-(2,5-dimethoxyphenyl)-2-[1-(2,4-dimethylphenyl)-4-methyl-7-oxo-pyrazolo[4,5-d]pyridazin-6-yl]aceta N-(2,5-dimethoxyphenyl)-2-[1-(2,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.18	1.43	-23.67	1	9	0	100	447.495	6	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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SQL Query Was

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